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Csse pyd2 modernize compute function #859

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Csse pyd2 modernize compute function

Csse pyd2 modernize compute function #859

Run time

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Job Run time
🐍 3.10 • Psi4-1.6 • ubuntu-latest
22m 52s
🐍 3.12 • Psi4-1.8 • windows-latest
40m 25s
🐍 3.8 • ANI • ubuntu-latest
2m 9s
🐍 3.8 • OpenMM • ubuntu-latest
4m 12s
🐍 3.10 • xTB • ubuntu-latest
1m 48s
🐍 3.8 • NWChem70 • ubuntu-20.04
19m 17s
🐍 3.12 • NWChem • ubuntu-latest
39m 25s
🐍 3.8 • MRChem • ubuntu-latest
47m 58s
🐍 3.8 • ADCC • ubuntu-latest
25m 32s
🐍 3.8 • optimization-dispersion • ubuntu-latest
30m 0s
🐍 3.11 • optimization-dispersion • windows-latest
41m 10s
🐍 3.10 • MACE • ubuntu-latest
2m 12s
🐍 3.11 • AIMNET2 • ubuntu-latest
1m 59s
🐍 3.10 • Sphinx
59s
4h 39m 58s